Electronic structure and optical properties of metallic nanoshells

TL;DR

This paper investigates the electronic and optical properties of metallic nanoshells using advanced quantum models, achieving accurate predictions of plasmon resonances and absorption spectra that align well with experimental data.

Contribution

It introduces an efficient numerical approach to model large nanoshells with realistic sizes and includes a frequency-dependent background polarizability in the TDLDA formalism.

Findings

Plasmon resonance energies match classical Mie scattering results.

Theoretical absorption spectra agree with experimental measurements.

Model can handle nanoshells with up to a million electrons.

Abstract

The electronic structure and optical properties of metallic nanoshells are investigated using a jellium model and the Time Dependent Local Density Approximation (TDLDA). An efficient numerical implementation enables applications to nanoshells of realistic size with up to a million electrons. We demonstrate how a frequency dependent background polarizability of the jellium shell can be included in the TDLDA formalism. The energies of the plasmon resonances are calculated for nanoshells of different sizes and with different dielectric cores, dielectric embedding media, and dielectric shell backgrounds. The plasmon energies are found to be in good agreement with the results from classical Mie scattering theory using a Drude dielectric function. A comparison with experimental data shows excellent agreement between theory and the measured frequency dependent absorption spectra.